Hexanonitrile, 6-fluoro-
TL;DR: Hexanonitrile, 6-fluoro- (CAS 373-31-9) is a chemical compound with molecular formula C6H10FN and molecular weight 115.07973 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-fluorohexanenitrile
Also Known As: 6-fluorohexanenitrile, 6-Fluorohexanonitrile, HEXANONITRILE, 6-FLUORO-, 4-02-00-00932 (Beilstein Handbook Reference), BRN 1744170
Technical Specifications
| Molecular Formula | C6H10FN |
| Molecular Weight | 115.07973 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 115.07973 Da |
| Heavy Atoms | 8 |
| Complexity | 81.0 |
| SMILES | C(CCC#N)CCF |
| InChIKey | XQPCYRPIZBEDDJ-UHFFFAOYSA-N |
Chemical Property Profile of Hexanonitrile, 6-fluoro-
Property Insights of Hexanonitrile, 6-fluoro-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexanonitrile, 6-fluoro-. With a topological polar surface area (TPSA) of 23.8 Ų, Hexanonitrile, 6-fluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexanonitrile, 6-fluoro- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Hexanonitrile, 6-fluoro-?
The CAS number of Hexanonitrile, 6-fluoro- is 373-31-9.
What is the molecular formula of Hexanonitrile, 6-fluoro-?
The molecular formula of Hexanonitrile, 6-fluoro- is C6H10FN.
What is the molecular weight of Hexanonitrile, 6-fluoro-?
The molecular weight of Hexanonitrile, 6-fluoro- is 115.07973 g/mol.
Where can I buy Hexanonitrile, 6-fluoro-?
You can request a quote for Hexanonitrile, 6-fluoro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Hexanonitrile, 6-fluoro-?
Yes, CoreyChem provides custom synthesis services for Hexanonitrile, 6-fluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.